Geometry & MOs

Info

ID:	295344
PubChem CID:	117526917
Reduced:	N3C16H25 (1)
Stoich.:	A3B16C25 (1)
Weight, g/mol:	254.121927
ΔH_f, kcal/mol:	4.12
Dipole, Da:	4.74
IP(EA), eV:	-8.75(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-fluorophenyl)ethyl]-6-methyl-1H-benzimidazole

Drug info:

PubChemData

Smile

CC(C)CC1=NC2=C(N1)C=C(C=C2)C(CN)C(C)C

DOS

IR

Vibrations